3-[[(2S)-5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl]sulfamoyl]-4-methyl-benzoate

Systemtic Name: 3-[[(2S)-5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl]sulfamoyl]-4-methyl-benzoate Openeye Name: 3-[[(2S)-5-ethoxy-2-methyl-2,3-dihydrobenzofuran-6-yl]sulfamoyl]-4-methyl-benzoate CAS Name: 3-[[(2S)-5-ethoxy-2-methyl-2,3-dihydrobenzofuran-6-yl]sulfamoyl]-4-methylbenzoate IUPAC Name: 3-[[(2S)-5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl]sulfamoyl]-4-methylbenzoate Traditional Name: 3-[[(2S)-5-ethoxy-2-methyl-coumaran-6-yl]sulfamoyl]-4-methyl-benzoate Formula: C19H20NO6S- MolecularWeight: 390.4302

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C2C(=C1)CC(O2)C)NS(=O)(=O)C3=C(C=CC(=C3)C(=O)[O-])C

Isomeric SMILES

CCOC1=C(C=C2C(=C1)C[C@@H](O2)C)NS(=O)(=O)C3=C(C=CC(=C3)C(=O)[O-])C

InChI

InChI=1S/C19H21NO6S/c1-4-25-17-8-14-7-12(3)26-16(14)10-15(17)20-27(23,24)18-9-13(19(21)22)6-5-11(18)2/h5-6,8-10,12,20H,4,7H2,1-3H3,(H,21,22)/p-1/t12-/m0/s1